MMs00577637 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2353 0.8509 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6498 0.3516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0773 -1.0862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5617 1.5426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7108 2.7779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2101 4.1924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2731 2.3504 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0821 3.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0612 1.5048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7783 0.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2779 0.1496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0603 1.4294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3432 2.7469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8437 2.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1257 4.0266 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.5598 1.3916 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5221 -0.1079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5976 2.8912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0593 1.3539 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7764 0.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2760 -0.0013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9930 -1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4926 -1.3566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2750 -0.0768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5579 1.2407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0584 1.2784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6807 0.9883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9883 -0.6807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6807 -0.9883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8116 4.2151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8707 3.9919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6474 2.3096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1524 -0.8365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8515 -0.9044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 3.8386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6853 2.3777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6388 -0.3455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9550 -1.1502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3671 -2.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0662 -2.4106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4746 -0.1070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1839 2.2645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4847 2.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END